canSAR1534566
FEATURES
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NAMES
    SMILES
    COc1ccc2c(CNCc3ccc(C)o3)c(C(=O)O)n(Cc3ccccc3C)c2c1
    InChI
    InChI=1S/C25H26N2O4/c1-16-6-4-5-7-18(16)15-27-23-12-19(30-3)10-11-21(23)22(24(27)25(28)29)14-26-13-20-9-8-17(2)31-20/h4-12,26H,13-15H2,1-3H3,(H,28,29)
    MOLECULAR FORMULA
    C25H26N2O4
    CROSS REFERENCES
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    canSAR1534566
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight418.19
    AlogP4.90
    HBond donors2
    HBond acceptors6
    Atoms57
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1534566.